PUBCHEM-ZINC05851059 MOE2007 3D CORINA 3.40 0006 02.08.2006 23 22 0 0 1 0 0 0 0 0999 V2000 0.1020 1.3610 -0.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2830 0.2270 0.6100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7200 0.0220 1.6660 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1510 -0.7020 2.8310 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 -2.0580 2.5650 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.3130 -1.9520 1.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1940 -2.5860 3.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8900 -3.9130 3.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2780 -4.6340 2.6960 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4080 -3.0220 2.0990 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0990 -3.8900 2.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8560 -0.4670 1.2170 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7840 -0.2050 1.9910 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0090 1.1270 -0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7040 1.5340 -1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 2.2940 0.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2430 0.5090 1.0620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4580 -0.6890 0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9330 -0.8440 3.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5790 -0.0270 3.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4370 -2.7810 4.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9150 -1.8620 4.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9600 -4.1230 4.1770 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 1 16 1 0 0 0 0 2 3 1 0 0 0 0 2 17 1 0 0 0 0 2 18 1 0 0 0 0 3 4 1 0 0 0 0 3 12 1 0 0 0 0 4 5 1 0 0 0 0 4 19 1 0 0 0 0 4 20 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 10 1 0 0 0 0 7 8 1 0 0 0 0 7 21 1 0 0 0 0 7 22 1 0 0 0 0 8 9 2 0 0 0 0 8 23 1 0 0 0 0 10 11 1 0 0 0 0 12 13 2 0 0 0 0 M CHG 1 23 -1 M END